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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP038253

methyl (2S,3S,3aR,6R,7S,7aR)-3-hydroxy-7-[(2S)-2-hydroxy-2-(2-hydroxy-5-oxo-2H-furan-3-yl)ethyl]-3,3a,6,7-tetramethyl-1,2,4,5,6,7a-hexahydroindene-2-carboxylate

Formula: C21H32O7  |  Mol. Weight: 396.50 g/mol

IUPAC: methyl (2S,3S,3aR,6R,7S,7aR)-3-hydroxy-7-[(2S)-2-hydroxy-2-(2-hydroxy-5-oxo-2H-furan-3-yl)ethyl]-3,3a,6,7-tetramethyl-1,2,4,5,6,7a-hexahydroindene-2-carboxylate

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Overview

Molecular Formula C21H32O7
Molecular Weight 396.50 g/mol
Canonical SMILES CC1CCC2(C(C1(C)CC(C3=CC(=O)OC3O)O)CC(C2(C)O)C(=O)OC)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy